5-acetamido-2-methyl-3-nitro-benzoic acid

Systemtic Name: 5-acetamido-2-methyl-3-nitro-benzoic acid Openeye Name: 5-acetamido-2-methyl-3-nitro-benzoic acid CAS Name: 5-acetamido-2-methyl-3-nitrobenzoic acid IUPAC Name: 5-acetamido-2-methyl-3-nitrobenzoic acid Traditional Name: 5-acetamido-2-methyl-3-nitro-benzoic acid Formula: C10H10N2O5 MolecularWeight: 238.1968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1C(=O)O)NC(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1C(=O)O)NC(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C10H10N2O5/c1-5-8(10(14)15)3-7(11-6(2)13)4-9(5)12(16)17/h3-4H,1-2H3,(H,11,13)(H,14,15)